(Z)-3-diethylboranyl-2-[hydroxy(dimethyl)silyl]-N,N-dimethylpent-2-en-1-amine

C13H30BNOSi — CID 102327355

IUPAC(Z)-3-diethylboranyl-2-[hydroxy(dimethyl)silyl]-N,N-dimethylpent-2-en-1-amine
SMILESCCB(CC)/C(CC)=C(\CN(C)C)[Si](C)(C)O
InChIInChI=1S/C13H30BNOSi/c1-8-12(14(9-2)10-3)13(11-15(4)5)17(6,7)16/h16H,8-11H2,1-7H3/b13-12+
InChIKeyBDKADIMNOHEKKL-OUKQBFOZSA-N
MW255.29 g/mol
LogP3.07
Rot. Bonds7

About (Z)-3-diethylboranyl-2-[hydroxy(dimethyl)silyl]-N,N-dimethylpent-2-en-1-amine

(Z)-3-diethylboranyl-2-[hydroxy(dimethyl)silyl]-N,N-dimethylpent-2-en-1-amine (PubChem CID 102327355) has the molecular formula C13H30BNOSi and a molecular weight of 255.29 g/mol. Its IUPAC name is (Z)-3-diethylboranyl-2-[hydroxy(dimethyl)silyl]-N,N-dimethylpent-2-en-1-amine.

Molecular Properties

Compound Name(Z)-3-diethylboranyl-2-[hydroxy(dimethyl)silyl]-N,N-dimethylpent-2-en-1-amine
PubChem CID102327355
Molecular FormulaC13H30BNOSi
Molecular Weight255.29 g/mol
Exact Mass255.22
IUPAC Name(Z)-3-diethylboranyl-2-[hydroxy(dimethyl)silyl]-N,N-dimethylpent-2-en-1-amine
SMILESCCB(CC)/C(CC)=C(\CN(C)C)[Si](C)(C)O
InChIInChI=1S/C13H30BNOSi/c1-8-12(14(9-2)10-3)13(11-15(4)5)17(6,7)16/h16H,8-11H2,1-7H3/b13-12+
InChIKeyBDKADIMNOHEKKL-OUKQBFOZSA-N
XLogP3.07
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.29
LogP ≤ 53.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (Z)-3-diethylboranyl-2-[hydroxy(dimethyl)silyl]-N,N-dimethylpent-2-en-1-amine?
The IUPAC name of (Z)-3-diethylboranyl-2-[hydroxy(dimethyl)silyl]-N,N-dimethylpent-2-en-1-amine (CID 102327355) is (Z)-3-diethylboranyl-2-[hydroxy(dimethyl)silyl]-N,N-dimethylpent-2-en-1-amine.
What is the SMILES notation for (Z)-3-diethylboranyl-2-[hydroxy(dimethyl)silyl]-N,N-dimethylpent-2-en-1-amine?
The canonical SMILES for (Z)-3-diethylboranyl-2-[hydroxy(dimethyl)silyl]-N,N-dimethylpent-2-en-1-amine is CCB(CC)/C(CC)=C(\CN(C)C)[Si](C)(C)O.
What is the InChIKey of (Z)-3-diethylboranyl-2-[hydroxy(dimethyl)silyl]-N,N-dimethylpent-2-en-1-amine?
The InChIKey is BDKADIMNOHEKKL-OUKQBFOZSA-N. The full InChI is InChI=1S/C13H30BNOSi/c1-8-12(14(9-2)10-3)13(11-15(4)5)17(6,7)16/h16H,8-11H2,1-7H3/b13-12+.
What are the key properties of (Z)-3-diethylboranyl-2-[hydroxy(dimethyl)silyl]-N,N-dimethylpent-2-en-1-amine?
(Z)-3-diethylboranyl-2-[hydroxy(dimethyl)silyl]-N,N-dimethylpent-2-en-1-amine has a molecular weight of 255.29 g/mol, XLogP of 3.07, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-3-diethylboranyl-2-[hydroxy(dimethyl)silyl]-N,N-dimethylpent-2-en-1-amine is sourced from PubChem (CID 102327355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).